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CAS 2800-96-6 TIN(IV) ACETATE molecular structure lightbox
CAS RN: 2800-96-6

TIN(IV) ACETATE

  • Product code: SSC-128549
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 0.25g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 2800-96-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 0 Out of Stock Shenzhen Inquiry

2800-96-6 / tin(4+) tetraacetate

Standard CAS: 2800-96-6 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
2800-96-6
Multi CAS
No
Molecular Formula
C8H12O8Sn
Molecular Weight
354.890000
Exact Mass
355.955420
SMILES
CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].[Sn+4]
InChI
InChI=1S/4C2H4O2.Sn/c4*1-2(3)4;/h4*1H3,(H,3,4);/q;;;;+4/p-4
InChIKey
YJGJRYWNNHUESM-UHFFFAOYSA-J

Computed Properties

Structural Parameters

Heavy atom count
17
Fraction Csp3
0.5
H-bond acceptors
8
Molar refractivity
48.48
TPSA
160.52

LogP / Solubility

WLOGP
-5.36
MLOGP
-4.69
XLogP3
-5.36
Consensus LogP
-5.14
Log S (ESOL)
1.33
Class (ESOL)
Highly soluble
Log S (Ali)
1.4
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
2.48
Class (SILICOS-IT)
Highly soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-8.69

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

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